2-Amino-9-methyl-4,8,10-octadecatriene-1,3-diol; (2S,3R,4E,8E,10E)-form, N-(2R-Hydroxyheptadecanoyl), 1-O-β-D-glucopyranoside
AlkaPlorer ID: AK286412
Synonym: Phalluside 3
IUPAC Name: None
Structure
SMILES: CCCCCCC/C=C/C(C)=C/CC/C=C/C(O)C(COC1OC(CO)C(O)C(O)C1O)NC(=O)C(O)CCCCCCCCCCCCCCC
InChI: InChI=1S/C42H77NO9/c1-4-6-8-10-12-13-14-15-16-17-19-21-25-30-36(46)41(50)43-34(32-51-42-40(49)39(48)38(47)37(31-44)52-42)35(45)29-26-22-24-28-33(3)27-23-20-18-11-9-7-5-2/h23,26-29,34-40,42,44-49H,4-22,24-25,30-32H2,1-3H3,(H,43,50)/b27-23+,29-26+,33-28+
InChIKey: FQEXKDYDJPBGDO-GSFQMVIPSA-N
Reference
CAS: 213622-89-0
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Phallusia fumigata | Phallusia | Ascidiidae | Phlebobranchia | Ascidiacea | Chordata | Metazoa | Eukaryota |
| Cosmasterias lurida | Cosmasterias | Asteriidae | Forcipulatida | Asteroidea | Echinodermata | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 740.0759999999992
TPSA？: 168.94
MolLogP？: 6.690200000000007
Number of H-Donors: 7
Number of H-Acceptors: 9
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|